4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide

C20H21FN2O2 — CID 109150302

IUPAC4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide
SMILESO=C(Nc1ccccc1)C1CCC(C(=O)Nc2ccc(F)cc2)CC1
InChIInChI=1S/C20H21FN2O2/c21-16-10-12-18(13-11-16)23-20(25)15-8-6-14(7-9-15)19(24)22-17-4-2-1-3-5-17/h1-5,10-15H,6-9H2,(H,22,24)(H,23,25)
InChIKeyBLYJDXAWGBEOAQ-UHFFFAOYSA-N
MW340.40 g/mol
LogP4.21
Rot. Bonds4

About 4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide

4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide (PubChem CID 109150302) has the molecular formula C20H21FN2O2 and a molecular weight of 340.40 g/mol. Its IUPAC name is 4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide
PubChem CID109150302
Molecular FormulaC20H21FN2O2
Molecular Weight340.40 g/mol
Exact Mass340.16
IUPAC Name4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide
SMILESO=C(Nc1ccccc1)C1CCC(C(=O)Nc2ccc(F)cc2)CC1
InChIInChI=1S/C20H21FN2O2/c21-16-10-12-18(13-11-16)23-20(25)15-8-6-14(7-9-15)19(24)22-17-4-2-1-3-5-17/h1-5,10-15H,6-9H2,(H,22,24)(H,23,25)
InChIKeyBLYJDXAWGBEOAQ-UHFFFAOYSA-N
XLogP4.21
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-fluorophenyl)cyclopropanecarboxamide
CID 532027
1-[2-(4-fluoroanilino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 9134233
4-N-(3,5-dimethylphenyl)-1-N-(4-fluorophenyl)cyclohexane-1,4-dicarboxamide
CID 109150694
4-N-(4-acetylphenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide
CID 109150327
4-(carbamoylamino)-N-(4-fluorophenyl)cyclohexane-1-carboxamide
CID 47069861
(3S)-3-N-(4-fluorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide
CID 9070375
N-(4-anilinophenyl)-4-methylcyclohexane-1-carboxamide
CID 110178754
1-N-(4-acetamidophenyl)-4-N-(3-fluorophenyl)cyclohexane-1,4-dicarboxamide
CID 109151103
[2-(4-fluoroanilino)-2-oxo-1-phenylethyl] 4-(cyclopropanecarbonylamino)benzoate
CID 55320929
1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide
CID 17152616
3-amino-N-(4-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670664
4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(4-fluorophenyl)cyclohexane-1-carboxamide
CID 109149043

Frequently Asked Questions

What is the IUPAC name of 4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide?
The IUPAC name of 4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide (CID 109150302) is 4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide.
What is the SMILES notation for 4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide?
The canonical SMILES for 4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide is O=C(Nc1ccccc1)C1CCC(C(=O)Nc2ccc(F)cc2)CC1.
What is the InChIKey of 4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide?
The InChIKey is BLYJDXAWGBEOAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O2/c21-16-10-12-18(13-11-16)23-20(25)15-8-6-14(7-9-15)19(24)22-17-4-2-1-3-5-17/h1-5,10-15H,6-9H2,(H,22,24)(H,23,25).
What are the key properties of 4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide?
4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide has a molecular weight of 340.40 g/mol, XLogP of 4.21, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide is sourced from PubChem (CID 109150302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).